4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one

C18H21N5O2 — CID 155974492

IUPAC4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one
SMILESCOc1cc(N2CCN(c3cc(C)nc(C4CC4)n3)CC2=O)ccn1
InChIInChI=1S/C18H21N5O2/c1-12-9-15(21-18(20-12)13-3-4-13)22-7-8-23(17(24)11-22)14-5-6-19-16(10-14)25-2/h5-6,9-10,13H,3-4,7-8,11H2,1-2H3
InChIKeyUDOILGUCSVKRDF-UHFFFAOYSA-N
MW339.40 g/mol
LogP1.92
Rot. Bonds4

About 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one

4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one (PubChem CID 155974492) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one.

Molecular Properties

Compound Name4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one
PubChem CID155974492
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC Name4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one
SMILESCOc1cc(N2CCN(c3cc(C)nc(C4CC4)n3)CC2=O)ccn1
InChIInChI=1S/C18H21N5O2/c1-12-9-15(21-18(20-12)13-3-4-13)22-7-8-23(17(24)11-22)14-5-6-19-16(10-14)25-2/h5-6,9-10,13H,3-4,7-8,11H2,1-2H3
InChIKeyUDOILGUCSVKRDF-UHFFFAOYSA-N
XLogP1.92
TPSA71.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-methoxy-4-pyridinyl)-4-(6-methoxypyrimidin-4-yl)piperazin-2-one
CID 155974547
6-[4-(2-methoxy-4-pyridinyl)-3-oxopiperazin-1-yl]pyridine-3-carbonitrile
CID 139022978
4-cyclopropylsulfonyl-1-(2-methoxy-4-pyridinyl)piperazin-2-one
CID 139023028
4-(3-fluoro-2-pyridinyl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one
CID 163343878
1-benzyl-4-(2-cyclopropyl-6-methylpyrimidin-4-yl)piperazin-2-one;hydrochloride
CID 154580874
4-(6-ethyl-5-fluoropyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one
CID 139022999
4-[2-(methoxymethyl)-6-methylpyrimidin-4-yl]-1-(1-methylpyrazol-4-yl)piperazin-2-one
CID 133336876
4-(4-methoxypyrimidin-2-yl)-1-[2-(trifluoromethyl)-4-pyridinyl]piperazin-2-one
CID 139028770
4-(2,5-dimethylfuran-3-carbonyl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one
CID 139023042
4-(2-bromophenyl)sulfonyl-1-(2-methoxy-4-pyridinyl)piperazin-2-one
CID 138988472
4-[6-[4-(2-cyclopropyl-6-methylpyrimidin-4-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 146079760
2-cyclopropyl-4-methyl-6-[3-(4-pyridin-2-ylpiperazin-1-yl)azetidin-1-yl]pyrimidine
CID 126893435

Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one?
The IUPAC name of 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one (CID 155974492) is 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one.
What is the SMILES notation for 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one?
The canonical SMILES for 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one is COc1cc(N2CCN(c3cc(C)nc(C4CC4)n3)CC2=O)ccn1.
What is the InChIKey of 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one?
The InChIKey is UDOILGUCSVKRDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O2/c1-12-9-15(21-18(20-12)13-3-4-13)22-7-8-23(17(24)11-22)14-5-6-19-16(10-14)25-2/h5-6,9-10,13H,3-4,7-8,11H2,1-2H3.
What are the key properties of 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one?
4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one has a molecular weight of 339.40 g/mol, XLogP of 1.92, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropyl-6-methylpyrimidin-4-yl)-1-(2-methoxy-4-pyridinyl)piperazin-2-one is sourced from PubChem (CID 155974492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).